hydroxy{[4-({4-[(2-methyl-4-quinolinyl)methyl]phenyl}sulfonyl)tetrahydro-2H-pyran-4-yl]methyl}formamide | 1026390-79-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: hydroxy{[4-({4-[(2-methyl-4-quinolinyl)methyl]phenyl}sulfonyl)tetrahydro-2H-pyran-4-yl]methyl}formamide
• 英文别名: [4-[4-[(2-Methylquinolin-4-yl)methyl]phenyl]sulfonyloxan-4-yl]methylcarbamic acid
• CAS: 1026390-79-3
• 化学式: C₂₄H₂₆N₂O₅S
• 分子量: 454.547
• InChiKey: ORQFYKNVUFPPTR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  32
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  114
• 氢给体数：
  2
• 氢受体数：
  6

文献信息

• Beta-sulfone derivatives as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE)
  申请人：——

  公开号：US20030212056A1

  公开（公告）日：2003-11-13

  The present application describes novel &bgr;-sulfone derivatives of formula I: 1 or pharmaceutically acceptable salt or prodrug forms thereof, wherein R 1 , R 2 , R 3 , R 4 , R 5 , X, Y, Z, and Z a are defined in the present specification, which are useful as inhibitors of matrix metalloproteinases (MMP), TNF-&agr; converting enzyme (TACE), aggrecanase, or a combination thereof.

  本申请描述了新颖的β-砜衍生物，化学式为I:1或其药用可接受的盐或前药形式，其中R1、R2、R3、R4、R5、X、Y、Z和Za在本说明中有定义，这些衍生物可用作基质金属蛋白酶（MMP）、TNF-α转化酶（TACE）、聚集素酶的抑制剂，或其组合。
• [EN] beta -SULFONE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF- alpha CONVERTING ENZYME (TACE)<br/>[FR] DERIVES DOLLAR G(B)-SULFONE UTILISES COMME INHIBITEURS DE METALLOPROTEINASES MATRICIELLES ET/OU ENZYME DE CONVERSION DE TNF- DOLLAR G(A) (TACE)
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2003040103A1

  公开（公告）日：2003-05-15

  The present application describes novel β-sulfone derivatives of formula (I), or pharmaceutically acceptable salt or prodrug forms thereof, wherein R?1, R2, R3, R4, R5¿, X, Y, Z, and Za are defined in the present specification, which are useful as inhibitors of matrix metalloproteinases (MMP), TNF-α converting enzyme (TACE), aggrecanase, or a combination thereof.